methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate

C11H20N2O5 — CID 78953615

IUPACmethyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate
SMILESCCN(CC)C(=O)N(CC(=O)OC)CC(=O)OC
InChIInChI=1S/C11H20N2O5/c1-5-12(6-2)11(16)13(7-9(14)17-3)8-10(15)18-4/h5-8H2,1-4H3
InChIKeyLOLZGVHRXOHRIQ-UHFFFAOYSA-N
MW260.29 g/mol
LogP0.10
Rot. Bonds6

About methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate

methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate (PubChem CID 78953615) has the molecular formula C11H20N2O5 and a molecular weight of 260.29 g/mol. Its IUPAC name is methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate
PubChem CID78953615
Molecular FormulaC11H20N2O5
Molecular Weight260.29 g/mol
Exact Mass260.14
IUPAC Namemethyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate
SMILESCCN(CC)C(=O)N(CC(=O)OC)CC(=O)OC
InChIInChI=1S/C11H20N2O5/c1-5-12(6-2)11(16)13(7-9(14)17-3)8-10(15)18-4/h5-8H2,1-4H3
InChIKeyLOLZGVHRXOHRIQ-UHFFFAOYSA-N
XLogP0.10
TPSA76.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate?
The IUPAC name of methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate (CID 78953615) is methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate.
What is the SMILES notation for methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate?
The canonical SMILES for methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate is CCN(CC)C(=O)N(CC(=O)OC)CC(=O)OC.
What is the InChIKey of methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate?
The InChIKey is LOLZGVHRXOHRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O5/c1-5-12(6-2)11(16)13(7-9(14)17-3)8-10(15)18-4/h5-8H2,1-4H3.
What are the key properties of methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate?
methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate has a molecular weight of 260.29 g/mol, XLogP of 0.10, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[diethylcarbamoyl-(2-methoxy-2-oxoethyl)amino]acetate is sourced from PubChem (CID 78953615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).